SCHEMBL6832669

SCHEMBL6832669

O=C(O)N(C(=O)Nc1cccc2ccccc12)c1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
GAA P10253 2/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
MAPT P10636 3/20 0.53
GSK3B P49841 1/20 0.49
FABP7 O15540 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TRPV1 Q8NER1 1/20 0.47
POLB P06746 2/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA4 P43681 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8368814 0.87 KDM4E (0.53) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL3078087 0.85 KDM4E (0.59) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL9547527 0.83 KDM4E (0.59) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL16487448 0.82 SIGMAR1 (0.50) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL29140906 0.76 TRPV1 (0.76) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL11641269 0.76 KDM4E (0.62) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL6685254 0.76 SIGMAR1 (0.44) KDM4EGAAMAPTTSHRALDH1A1
SCHEMBL194475 0.75 KDM4E (0.71) KDM4EGAANPC1RAB9ACYP1A2
SCHEMBL6831348 0.74 SIGMAR1 (0.47) KDM4EGAAALDH1A1
Hydrochloric Acid SCHEMBL11157390 0.73 KDM4E (0.69) KDM4EGAANPC1RAB9ACYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472319-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2004-11-03 EP disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed